Geometry & MOs

Info

ID:	416185
PubChem CID:	135089194
Reduced:	O2N4C25H42 (1)
Stoich.:	A2B4C25D42 (1)
Weight, g/mol:	364.146617
ΔH_f, kcal/mol:	-72.4
Dipole, Da:	5.86
IP(EA), eV:	-8.49(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-chloro-2-fluorophenyl)-2-[4-(2-pyrazol-1-ylethyl)piperidin-1-yl]acetamide

Drug info:

PubChemData

Smile

CCN1CCN(CC1)CCOC2=CC=CC=C2CN3CC[C@]4(CCCN([C@@H]4C3)C)CO

DOS

IR

Vibrations